Vitas-M small molecule compound
N-[3-({[(3,4-dimethylphenyl)carbonyl]amino}methyl)-3,5,5-trimethylcyclohexyl]-3,4-dimethylbenzamide
Catalog ID
STK420948
SMILES O=C(c1ccc(c(c1)C)C)NCC1(C)CC(NC(=O)c2ccc(c(c2)C)C)CC(C1)(C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C28H38N2O2 MW 434.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H38N2O2/c1-18-8-10-22(12-20(18)3)25(31)29-17-28(7)15-24(14-27(5,6)16-28)30-26(32)23-11-9-19(2)21(4)13-23/h8-13,24H,14-17H2,1-7H3,(H,29,31)(H,30,32)InChIKey
KSIKJNIQBQLYQP-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)C(=O)NCC2(CC(CC(C2)(C)C)NC(=O)C3=CC(=C(C=C3)C)C)C)C
InChI=1SC28H38N2O2c11881022(1220(18)3)25(31)291728(7)1524(1427(56)1628)3026(32)2311919(2)21(4)1323h81324H1417H217H3(H2931)(H3032)
MFCD02174616
N((5((34DIMETHYLBENZOYL)AMINO)133TRIMETHYLCYCLOHEXYL)METHYL)34DIMETHYLBENZAMIDE
N(3((((34dimethylphenyl)carbonyl)amino)methyl)355trimethylcyclohexyl)34dimethylbenzamide
ZINC000002752490
ZINC000002752493
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